Simulation- and AI-directed optimization of 4,6-substituted 1,3,5-triazin-2(1H)-ones as inhibitors of human DNA topoisomerase IIα

Autor: Herlah, Barbara, Goričan, Tjaša, Benedik, Nika Strašek, Grdadolnik, Simona Golič, Sosič, Izidor, Perdih, Andrej
Zdroj: In Computational and Structural Biotechnology Journal December 2024 23:2995-3018
Databáze: ScienceDirect